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4,4'-{[1,2-亚苯基双(亚甲基)]双(氧)}二苯甲酸二甲基甲酰胺溶剂化物

4,4'-{[1,2-Phenyl-enebis(methyl-ene)]bis-(-oxy)}di-benzoic acid di-methyl-formamide disolvate.

作者信息

Qiu Zhen-Zhe, Jing Bi, Li Qiu-Xia, Zhu Ai-Xin

机构信息

Faculty of Chemistry and Chemical Engineering, Yunnan Normal University, Kunming 650050, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2014 Apr 12;70(Pt 5):o534-5. doi: 10.1107/S1600536814006795. eCollection 2014 May 1.

Abstract

In the title solvate, C22H18O6·2C3H7NO, the complete dicarboxylic acid molecule is generated by a crystallographic twofold axis, which bisects the central benzene ring and one N,N-di-methyl-formamide solvent mol-ecule. The dihedral angle between the central and pendant benzene rings is 54.53 (5)° while that between the pendant rings is 45.44 (5)°. In the crystal, the acid molecules are linked to the solvent molecules via O-H⋯O and weak C-H⋯O hydrogen bonds. Further weak C-H⋯O inter-actions link adjacent acid mol-ecules into a three-dimensional network.

摘要

在标题溶剂化物C22H18O6·2C3H7NO中,完整的二羧酸分子由一个晶体学二重轴生成,该二重轴将中心苯环和一个N,N - 二甲基甲酰胺溶剂分子平分。中心苯环与悬垂苯环之间的二面角为54.53 (5)°,而悬垂环之间的二面角为45.44 (5)°。在晶体中,酸分子通过O - H⋯O和弱C - H⋯O氢键与溶剂分子相连。进一步的弱C - H⋯O相互作用将相邻的酸分子连接成三维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d525/4011299/3241cef21537/e-70-0o534-fig1.jpg

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